In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2009 | 17 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(4-chlorophenyl)ethyl]-(2-hydroxyethyl)amino]ethanol 2-[[(1R)-2-amino-1-(4-chlorophen…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.14 | -1.86 | -51.19 | 5 | 4 | 1 | 71 | 259.757 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.14 | -0.27 | -31.57 | 5 | 4 | 1 | 71 | 259.757 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 0.04 | -120.29 | 6 | 4 | 2 | 73 | 260.765 | 7 | ↓ |